1-({(2S,4S)-1-[(3-ethylphenyl)carbamoyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-({(2S,4S)-1-[(3-ethylphenyl)carbamoyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
1-({(2S,4S)-1-[(3-ethylphenyl)carbamoyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1365 |
| Compound Name: | 1-({(2S,4S)-1-[(3-ethylphenyl)carbamoyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 360.39 |
| Molecular Formula: | C17 H21 F N6 O2 |
| Smiles: | CCc1cccc(c1)NC(N1C[C@H](C[C@H]1Cn1cc(C(N)=O)nn1)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.385 |
| logD: | 1.385 |
| logSw: | -2.1022 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.225 |
| InChI Key: | JIZUVFAVQZACDG-GXTWGEPZSA-N |